2-[2-ethylsulfanyl-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[2-ethylsulfanyl-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-3-yl]isoindole-1,3-dione Openeye Name: 2-[2-ethylsulfanyl-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]isoindoline-1,3-dione CAS Name: 2-[2-(ethylthio)-4,5-dihydroxy-6-(hydroxymethyl)-3-oxanyl]isoindole-1,3-dione IUPAC Name: 2-[2-ethylsulfanyl-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]isoindole-1,3-dione Traditional Name: 2-[2-(ethylthio)-4,5-dihydroxy-6-methylol-tetrahydropyran-3-yl]isoindoline-1,3-quinone Formula: C16H19NO6S MolecularWeight: 353.39016

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1C(C(C(C(O1)CO)O)O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCSC1C(C(C(C(O1)CO)O)O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H19NO6S/c1-2-24-16-11(13(20)12(19)10(7-18)23-16)17-14(21)8-5-3-4-6-9(8)15(17)22/h3-6,10-13,16,18-20H,2,7H2,1H3